3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
Chemical Structure Depiction of
3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
Compound characteristics
| Compound ID: | S629-1323 |
| Compound Name: | 3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide |
| Molecular Weight: | 368.43 |
| Molecular Formula: | C21 H24 N2 O4 |
| Smiles: | COc1cccc(CC(N2CCOc3ccc(CCC(N)=O)cc3C2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.3977 |
| logD: | 2.3977 |
| logSw: | -2.6228 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.235 |
| InChI Key: | JSTIUNXZEDQHPP-UHFFFAOYSA-N |